%chk=000268736.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268736

0 1
Br -0.810064 3.346887 1.525227
O -2.745510 1.280847 0.524607
O -1.914927 -2.532352 -1.108154
O -3.498127 -1.057450 -0.536927
C 2.658370 -0.471254 0.014436
C 1.186493 -0.062136 0.121115
C 2.829276 -1.858067 -0.632570
C 3.260480 -0.511104 1.432888
C 3.400660 0.567379 -0.849698
C 0.143949 -0.882480 -0.287368
C 0.877570 1.209620 0.665955
C -1.203155 -0.470120 -0.170275
C -0.432497 1.640500 0.793047
C -1.497691 0.801883 0.373914
C -2.303719 -1.323545 -0.596761
H 2.427262 -1.886018 -1.650984
H 3.889486 -2.128513 -0.702773
H 2.340478 -2.645421 -0.048964
H 2.709834 -1.203557 2.079295
H 4.304400 -0.841883 1.411827
H 3.244471 0.469893 1.917627
H 4.448216 0.283970 -0.998235
H 2.942397 0.660366 -1.840611
H 3.400198 1.562628 -0.394636
H 0.328636 -1.875101 -0.713041
H 1.695858 1.861858 0.991785
H -3.473027 0.622075 0.200806
H -2.699518 -3.086005 -1.388231


%chk=000268736-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268736

0 1
Br -0.853338 3.375362 1.598181
O -2.834843 1.262450 0.527547
O -1.973293 -2.535598 -1.161232
O -3.564213 -0.980320 -0.528611
C 2.682672 -0.476862 0.016363
C 1.196598 -0.068087 0.128803
C 2.852229 -1.885092 -0.608673
C 3.324872 -0.489899 1.436726
C 3.434462 0.552947 -0.880456
C 0.135367 -0.883692 -0.298134
C 0.861765 1.202278 0.692546
C -1.219730 -0.466672 -0.177806
C -0.465493 1.630279 0.819730
C -1.546228 0.813441 0.390124
C -2.332062 -1.309397 -0.619878
H 2.442487 -1.930947 -1.634550
H 3.927206 -2.133999 -0.667201
H 2.360657 -2.666512 -0.000177
H 2.819947 -1.223609 2.091195
H 4.393762 -0.764824 1.367240
H 3.263536 0.498796 1.925943
H 4.505215 0.285384 -0.949713
H 3.013636 0.567382 -1.902345
H 3.369588 1.578010 -0.473167
H 0.320982 -1.866320 -0.736352
H 1.656213 1.870741 1.039538
H -3.464824 0.543895 0.163718
H -2.797373 -3.026237 -1.426056


